CID 40153897

Methyl 2-[(3r)-piperidin-3-yl]acetate hydrochloride

Structural Information

Molecular Formula
C8H15NO2
SMILES
COC(=O)C[C@H]1CCCNC1
InChI
InChI=1S/C8H15NO2/c1-11-8(10)5-7-3-2-4-9-6-7/h7,9H,2-6H2,1H3/t7-/m1/s1
InChIKey
QDBQVCNGVFMIMU-SSDOTTSWSA-N
Compound name
methyl 2-[(3R)-piperidin-3-yl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

157.11028 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.117556 135.8
[M+Na]+ 180.099498 140.1
[M-H]- 156.103004 135.6
[M+NH4]+ 175.144103 154.3
[M+K]+ 196.073438 139.1
[M+H-H2O]+ 140.107540 129.5
[M+HCOO]- 202.108481 153.2
[M+CH3COO]- 216.124131 172.7
[M+Na-2H]- 178.084946 139.8
[M]+ 157.10973142 131.1
[M]- 157.11082858 131.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe